SCHEMBL25244416

SCHEMBL25244416

CN=S(C)(=O)c1cc(-c2cnn(C)c2C)cnc1Nc1cc(Nc2cc(C)nc(C)n2)ncn1

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 18/20 0.39
▸ PIK3C3 Q8NEB9 2/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL25241788 0.91 TYK2 (0.39) TYK2PIK3C3
SCHEMBL25282487 0.88 TYK2 (0.49) TYK2
SCHEMBL25287069 0.84 BACE1 (0.37) TYK2PIK3C3
SCHEMBL25242170 0.83 TYK2 (0.39) TYK2PIK3C3
SCHEMBL25240241 0.81 TYK2 (0.34) TYK2PIK3C3
SCHEMBL25289334 0.80 MAPT (0.31) TYK2PIK3C3
SCHEMBL25292442 0.80 TTK (0.41) TYK2
SCHEMBL25241375 0.79 TYK2 (0.49) TYK2
SCHEMBL25283616 0.78 PIK3C3 (0.34) TYK2PIK3C3
SCHEMBL25283690 0.78 PIK3C3 (0.31) PIK3C3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4206196-A1 PYRIMIDINE SUBSTITUTED DERIVATIVES AS TYK2 INHIBITORS Almirall S.A. (ES) 2023-07-05 — — EP claimed
EP-4206196-A1 PYRIMIDINE SUBSTITUTED DERIVATIVES AS TYK2 INHIBITORS Almirall S.A. (ES) 2023-07-05 — — EP disclosed
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